AMBER Archive (2004)

Subject: Re: AMBER: gaussian command line

From: FyD (fyd_at_u-picardie.fr)
Date: Fri Nov 05 2004 - 14:02:45 CST

> I am new to Gaussian. I want to use Gaussian to generate the input
> file for RESP. I don't know what I should put into the input line in
> Gaussian. Suppose I am going to use HF/6-31G(d) basis set. So in input
> line I type in" # HF/6-31G(d)", and anything else?

All is done automatically in R.E.D. See http://www.u-picardie.fr/labo/lbpd/RED/
& http://www.u-picardie.fr/labo/lbpd/RED/FAQ-I.htm
Francois
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